1LXC

Crystal Structure of E. Coli Enoyl Reductase-NAD+ with a Bound Acrylamide Inhibitor

Summary for 1LXC

• Entry DOI: 10.2210/pdb1lxc/pdb
• Related: 1C14 1I2Z 1I30 1LX6 1QG6
• Descriptor: ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH], NICOTINAMIDE-ADENINE-DINUCLEOTIDE, 3-(6-AMINOPYRIDIN-3-YL)-N-METHYL-N-[(1-METHYL-1H-INDOL-2-YL)METHYL]ACRYLAMIDE, ... (4 entities in total)
• Functional Keywords: fabi, enoyl reductase, oxidoreductase
• Biological source: Escherichia coli
• Total number of polymer chains: 2
• Total formula weight: 57753.48

Authors

Miller, W.H.,Seefeld, M.A.,Newlander, K.A.,Uzinskas, I.N.,Burgess, W.J.,Heerding, D.A.,Yuan, C.C.K.,Head, M.S.,Payne, D.J.,Rittenhouse, S.F.,Moore, T.D.,Pearson, S.C.,Dewolf, V.,Berry, W.E.,Keller, P.M.,Polizzi, B.J.,Qiu, X.,Janson, C.A.,Huffman, W.F. (deposition date: 2002-06-05, release date: 2002-09-04, Last modification date: 2024-02-14)

• Primary citation: Miller, W.H.,Seefeld, M.A.,Newlander, K.A.,Uzinskas, I.N.,Burgess, W.J.,Heerding, D.A.,Yuan, C.C.,Head, M.S.,Payne, D.J.,Rittenhouse, S.F.,Moore, T.D.,Pearson, S.C.,Berry, V.,DeWolf Jr., W.E.,Keller, P.M.,Polizzi, B.J.,Qiu, X.,Janson, C.A.,Huffman, W.F.; Discovery of aminopyridine-based inhibitors of bacterial enoyl-ACP reductase (FabI).; J.Med.Chem., 45:3246-3256, 2002; PubMed: 12109908; DOI: 10.1021/jm020050+

Experimental method

X-RAY DIFFRACTION (2.4 Å)